(E)-4-[(3-ethylpiperidin-1-yl)carbonylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3-ethylpiperidin-1-yl)carbonylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(3-ethylpiperidine-1-carbonyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[(3-ethyl-1-piperidinyl)-oxomethyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(3-ethylpiperidine-1-carbonyl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(3-ethylpiperidine-1-carbonyl)amino]-4-keto-but-2-enoic acid Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN(C1)C(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

CCC1CCCN(C1)C(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H18N2O4/c1-2-9-4-3-7-14(8-9)12(18)13-10(15)5-6-11(16)17/h5-6,9H,2-4,7-8H2,1H3,(H,16,17)(H,13,15,18)/b6-5+